General Information of the Compound
| Compound ID |
CP0487710
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| Compound Name |
methyl 3-[[benzyl(3,3-diphenylpropyl)carbamoyl]amino]benzoate
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| Structure |
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| Formula |
C31H30N2O3
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| Molecular Weight |
478.592
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| Canonical SMILES |
COC(=O)c1cccc(NC(=O)N(CCC(c2ccccc2)c2ccccc2)Cc2ccccc2)c1
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| InChI |
InChI=1S/C31H30N2O3/c1-36-30(34)27-18-11-19-28(22-27)32-31(35)33(23-24-12-5-2-6-13-24)21-20-29(25-14-7-3-8-15-25)26-16-9-4-10-17-26/h2-19,22,29H,20-21,23H2,1H3,(H,32,35)
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| InChIKey |
CXXMOYDDXQAZNI-UHFFFAOYSA-N
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| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
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Map of Molecular Bioactivity Related to the Compound
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Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
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Table of Molecular Bioactivities Related to the Compound